Cas no 1262010-00-3 (4-(3-Methoxycarbonylphenyl)nicotinic acid)
1262010-00-3 structure
Product Name:4-(3-Methoxycarbonylphenyl)nicotinic acid
CAS No:1262010-00-3
MF:C14H11NO4
MW:257.241443872452
CID:2769070
PubChem ID:53229442
Update Time:2025-04-21
4-(3-Methoxycarbonylphenyl)nicotinic acid Chemical and Physical Properties
Names and Identifiers
-
- MFCD18323598
- 1262010-00-3
- 4-(3-METHOXYCARBONYLPHENYL)NICOTINIC ACID
- 4-[3-(Methoxycarbonyl)phenyl]pyridine-3-carboxylic acid
- DTXSID40692625
- 4-(3-Methoxycarbonylphenyl)nicotinic acid, 95%
- 4-(3-Methoxycarbonylphenyl)nicotinic acid
-
- Inchi： 1S/C14H11NO4/c1-19-14(18)10-4-2-3-9(7-10)11-5-6-15-8-12(11)13(16)17/h2-8H,1H3,(H,16,17)
- InChI Key： NZGJXZYRZYRQOO-UHFFFAOYSA-N
- SMILES： O(C)C(C1=CC=CC(=C1)C1C=CN=CC=1C(=O)O)=O
Computed Properties
- Exact Mass: 257.069
- Monoisotopic Mass: 257.069
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 19
- Rotatable Bond Count: 4
- Complexity: 344
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 76.5A^2
- XLogP3: 1.9
4-(3-Methoxycarbonylphenyl)nicotinic acid Related Literature
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
1262010-00-3 (4-(3-Methoxycarbonylphenyl)nicotinic acid) Related Products
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